N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N'-methyl-N'-phenethyl-ethanediamide

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N'-methyl-N'-phenethyl-ethanediamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N'-methyl-N'-phenethyl-oxamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-N'-methyl-N'-phenethyloxamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-N'-methyl-N'-phenethyloxamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N'-methyl-N'-phenethyl-oxamide Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N(C)CCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N(C)CCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H28N6O3/c1-18(32)26-14-15-27-21-17-22(29-23(28-21)20-11-7-4-8-12-20)30-24(33)25(34)31(2)16-13-19-9-5-3-6-10-19/h3-12,17H,13-16H2,1-2H3,(H,26,32)(H2,27,28,29,30,33)